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Home > Indoles and Oxindole > 1263210-96-3
1263210-96-3 | 1-ALLYL-1H-INDOLE-3-CARBONITRILE
CAS No: 1263210-96-3 Catalog No: AG01DKWD MDL No:
Product Description
Catalog Number:
AG01DKWD
Chemical Name:
1-ALLYL-1H-INDOLE-3-CARBONITRILE
CAS Number:
1263210-96-3
IUPAC Name:
1-prop-2-enylindole-3-carbonitrile
InChI:
InChI=1S/C12H10N2/c1-2-7-14-9-10(8-13)11-5-3-4-6-12(11)14/h2-6,9H,1,7H2
InChI Key:
VBPKBZRNDIHUCK-UHFFFAOYSA-N
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.226g/mol
Monoisotopic Mass:
182.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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